UCSF

ZINC00390416

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 24th, 2004 15 Yes

Popular Name: Methyl 4-(4-fluorophenyl)-4-oxobutanoate Methyl 4-(4-fluorophenyl)-4-oxob…

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CAS Number: 39560-31-1

Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.72 3.42 -6.78 0 3 0 43 210.204 5 ↓

Vendor Notes

Note Type Comments Provided By
MP 42-44° Fluorochem
Purity 95% Fluorochem

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )